UCSF

ZINC00164246

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 No

Popular Name: 5-Chloroindole-3-carboxaldehyde 5-Chloroindole-3-carboxaldehyde

Find On: PubMed — Wikipedia — Google

CAS Numbers: 827-01-0 , [827-01-0]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.53 0.42 -14.93 1 2 0 33 179.606 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 210-212? Alfa-Aesar
Melting_Point 210-212° Alfa-Aesar
Purity 95% Fluorochem
Purity 98% APIChem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )